6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 2082-0205 |
| Compound Name: | 6-[2-(3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 289.24 |
| Molecular Formula: | C13 H11 N3 O5 |
| Smiles: | COc1cccc(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.8366 |
| logD: | -1.2782 |
| logSw: | -2.3596 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.952 |
| InChI Key: | HZHRPAGNRIOZKF-UHFFFAOYSA-N |